[gmx-users] how to generate a trr file
subhomoy.bk at gmail.com
Sun Sep 17 18:18:27 CEST 2017
You can use "trjconv" command and specify "-e 50000".
Hope it helps!!
On 17 Sep 2017 8:34 pm, "marzieh dehghan" <dehghanmarzieh at gmail.com> wrote:
> Dear all
> I performed molecular dynamics simulation during 100 ns, but now I want to
> create a trr or xtc file including 50 ns. how I can generate trajectory
> file containing 50 ns from 100 ns of MD run?
> thanks a lot
> best wishes
> *Marzieh DehghanPhD of BiochemistryInstitute of biochemistry and Biophysics
> (IBB)University of Tehran, Tehran- Iran.*
> Gromacs Users mailing list
> * Please search the archive at http://www.gromacs.org/
> Support/Mailing_Lists/GMX-Users_List before posting!
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.
More information about the gromacs.org_gmx-users